Note that elemental potentials taken from alloy descriptions may not work well for the pure species. This is particularly true if the elements were fit for compounds instead of being optimized separately. As with all interatomic potentials, please check to make sure that the performance is adequate for your problem.
Uranium-Nitrogen (U-N) SystemTseplyaev, V.I., and S.V. Starikov. "The Atomistic Simulation of Pressure-Induced Phase Transition in Uranium Mononitride." Journal of Nuclear Materials. Elsevier BV, November 2016. DOI: 10.1016/j.jnucmat.2016.07.048
Notes: These files were sent by S.V. Starikov (Joint Institute for High Temperatures, Russian Academy of Sciences) on 3 Nov. 2016 and posted with his permission.
Format: ADP extended setfl
Date created: October 5, 2010 | Last updated: November 13, 2017